3-[[4-[1-(6-azanylpyridin-3-yl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-yl]amino]propanenitrile

Systemtic Name: 3-[[4-[1-(6-azanylpyridin-3-yl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-yl]amino]propanenitrile Openeye Name: 3-[[4-[1-(6-amino-3-pyridyl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-yl]amino]propanenitrile CAS Name: 3-[[4-[1-(6-amino-3-pyridinyl)-2-benzimidazolyl]-1,2,5-oxadiazol-3-yl]amino]propanenitrile IUPAC Name: 3-[[4-[1-(6-aminopyridin-3-yl)benzimidazol-2-yl]-1,2,5-oxadiazol-3-yl]amino]propanenitrile Traditional Name: 3-[[4-[1-(6-amino-3-pyridyl)benzimidazol-2-yl]furazan-3-yl]amino]propionitrile Formula: C17H14N8O MolecularWeight: 346.34606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2C3=CN=C(C=C3)N)C4=NON=C4NCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2C3=CN=C(C=C3)N)C4=NON=C4NCCC#N

InChI

InChI=1S/C17H14N8O/c18-8-3-9-20-16-15(23-26-24-16)17-22-12-4-1-2-5-13(12)25(17)11-6-7-14(19)21-10-11/h1-2,4-7,10H,3,9H2,(H2,19,21)(H,20,24)